Marvin  11070611252D          

  7  6  0  0  0  0            999 V2000
   -0.7145   -0.0589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.4714    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.0589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    0.7661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    0.7661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -0.4714    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -0.4714    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  2  0  0  0  0
  1  7  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  6  1  0  0  0  0
M  END
> <ID>
CHEBI:18138

> <NAME>
biuret

> <DEFINITION>
A member of the class of condensed ureas that is the compound formed by the condensation of two molecules of urea; the parent compound of the biuret group of compounds. Used as a non-protein nitrogen source in ruminant feed.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:3135; CHEBI:13916; CHEBI:22903

> <SYNONYM>
ureidoformamide; imidodicarbonic diamide; dicarbonimidic diamide; carbamoylurea; carbamoylurea; biuret; Biuret; allophanamide; (aminocarbonyl)urea

> <IUPAC_NAME>
2-imidodicarbonic diamide

> <FORMULA>
C2H5N3O2

> <MASS>
103.08012

> <MONOISOTOPIC_MASS>
103.03818

> <CHARGE>
0

> <SMILES>
NC(=O)NC(N)=O

> <INCHI>
InChI=1S/C2H5N3O2/c3-1(6)5-2(4)7/h(H5,3,4,5,6,7)

> <INCHIKEY>
OHJMTUPIZMNBFR-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
1703510

> <CAS_REGISTRY_NUMBER>
108-19-0

> <GMELIN_REGISTRY_NUMBER>
49702

> <REAXYS_REGISTRY_NUMBER>
1703510

> <CHEMIDPLUS>
108-19-0

> <KEGG_COMPOUND_ACCESSION>
C06555

> <METACYC_ACCESSION>
CPD-809

> <NIST_CHEMISTRY_WEBBOOK>
108-19-0

> <WIKIPEDIA_ACCESSION>
Biuret

> <PUBMED_CITATION>
24575873; 5391979

$$$$